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2-Acetyl-3-phenylsulfonyl-1,3-butadiene
SpectraBase Compound ID JKonw0GUcYw
InChI InChI=1S/C12H12O3S/c1-9(10(2)13)11(3)16(14,15)12-7-5-4-6-8-12/h4-8H,1,3H2,2H3
InChIKey VLCMCMPMPVMOIA-UHFFFAOYSA-N
Mol Weight 236.28 g/mol
Molecular Formula C12H12O3S
Exact Mass 236.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E3RlbQusLrJ
Name 2-Acetyl-3-phenylsulfonyl-1,3-butadiene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3S
InChI InChI=1S/C12H12O3S/c1-9(10(2)13)11(3)16(14,15)12-7-5-4-6-8-12/h4-8H,1,3H2,2H3
InChIKey VLCMCMPMPVMOIA-UHFFFAOYSA-N
Molecular Weight 236.285 g/mol
SMILES C=C(C(=C)S(=O)(=O)c1ccccc1)C(=O)C
SPLASH splash10-03di-0920000000-1aad9e4d21f4581699b5
Source of Spectrum SO-0-172-1
Synonyms 3-methylene-4-(phenylsulfonyl)-4-penten-2-one
Wiley ID 1541966